(3aR,6aR)-1,3a-dimethyl-6a-(3-oxidanylpropyl)-3,4,5,6-tetrahydro-1H-pentalen-2-one

Systemtic Name: (3aR,6aR)-1,3a-dimethyl-6a-(3-oxidanylpropyl)-3,4,5,6-tetrahydro-1H-pentalen-2-one Openeye Name: (3aR,6aR)-6a-(3-hydroxypropyl)-1,3a-dimethyl-3,4,5,6-tetrahydro-1H-pentalen-2-one CAS Name: (3aR,6aR)-6a-(3-hydroxypropyl)-1,3a-dimethyl-3,4,5,6-tetrahydro-1H-pentalen-2-one IUPAC Name: (3aR,6aR)-6a-(3-hydroxypropyl)-1,3a-dimethyl-3,4,5,6-tetrahydro-1H-pentalen-2-one Traditional Name: (3aR,6aR)-6a-(3-hydroxypropyl)-1,3a-dimethyl-3,4,5,6-tetrahydro-1H-pentalen-2-one Formula: C13H22O2 MolecularWeight: 210.31258

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)CC2(C1(CCC2)CCCO)C

Isomeric SMILES

CC1C(=O)C[C@@]2([C@]1(CCC2)CCCO)C

InChI

InChI=1S/C13H22O2/c1-10-11(15)9-12(2)5-3-6-13(10,12)7-4-8-14/h10,14H,3-9H2,1-2H3/t10?,12-,13-/m1/s1